SCHEMBL790582

SCHEMBL790582

O=S(=O)(O)c1ccc2c(c1)Cc1ccccc1C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ING2 Q9H160 3/20 0.53
CA1 P00915 4/20 0.53
CA2 P00918 4/20 0.53
CA12 O43570 3/20 0.53
CA7 P43166 2/20 0.53
CA14 Q9ULX7 2/20 0.53
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
DRD2 P14416 2/20 0.42
DRD1 P21728 2/20 0.42
DRD5 P21918 2/20 0.42
DRD3 P35462 2/20 0.42
SNCA P37840 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29642689 1.00 ING2 (0.53) ING2CA1CA2CA12CA7
SCHEMBL11589913 0.94 ING2 (0.59) ING2CA1CA2CA12CA7
SCHEMBL28620166 0.94 ING2 (0.59) ING2CA1CA2CA12CA7
Ammonia Solution, Strong SCHEMBL27289512 0.92 ING2 (0.57) ING2CA1CA2CA12CA7
SCHEMBL15851432 0.87 KDM4E (0.57) ING2CA1CA2CA12CA7
Potassium SCHEMBL10575068 0.85 KDM4E (0.56) ING2CA1CA2CA12CA7
SCHEMBL9786190 0.83 KMT2A (0.58) ING2CA1CA2CA12CA7
SCHEMBL2951392 0.83 KMT2A (0.58) ING2CA1CA2CA12CA7
Potassium SCHEMBL2956797 0.82 KMT2A (0.56) ING2CA1CA2CA12CA7
SCHEMBL9786185 0.82 KMT2A (0.56) ING2CA1CA2CA12CA7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616449-A1 ANTHRAQUINONE COMPOUNDS AND THEIR USES Dundalk Institute of Technology (IE) 2013-07-24 EP claimed
WO-2012035122-A1 ANTHRAQUINONE COMPOUNDS AND THEIR USES DUNDALK INSTITUTE OF TECHNOLOGY (IE) 2012-03-22 WO claimed
WO-2021022258-A1 TETRACYCLINE COMPOUNDS FOR THE TREATMENT OF HEMATOLOGICAL CANCERS TETRAPHASE PHARMACEUTICALS, INC. (US) 2021-02-04 WO disclosed
US-20150119356-A1 Ophthalmic Viscoelastic Device CARL ZEISS MEDITEC AG (DE) 2015-04-30 US disclosed
EP-2846848-A1 OPHTHALMIC VISCOELASTIC DEVICE Carl Zeiss Meditec AG (DE) 2015-03-18 EP disclosed
WO-2013167632-A1 OPHTHALMIC VISCOELASTIC DEVICE CARL ZEISS MEDITEC AG (DE) 2013-11-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150119356-A1 Ophthalmic Viscoelastic Device UACA, ICAM1, VIM ING2 737/4885CA1 4767/4885CA2 3037/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.